2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine

C11H15F2N — CID 171811552

IUPAC2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine
SMILESCCC(C)(C)c1cccc(C(F)F)n1
InChIInChI=1S/C11H15F2N/c1-4-11(2,3)9-7-5-6-8(14-9)10(12)13/h5-7,10H,4H2,1-3H3
InChIKeyJXFLHBPVSSRRJL-UHFFFAOYSA-N
MW199.24 g/mol
LogP3.71
Rot. Bonds3

About 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine

2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine (PubChem CID 171811552) has the molecular formula C11H15F2N and a molecular weight of 199.24 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine
PubChem CID171811552
Molecular FormulaC11H15F2N
Molecular Weight199.24 g/mol
Exact Mass199.12
IUPAC Name2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine
SMILESCCC(C)(C)c1cccc(C(F)F)n1
InChIInChI=1S/C11H15F2N/c1-4-11(2,3)9-7-5-6-8(14-9)10(12)13/h5-7,10H,4H2,1-3H3
InChIKeyJXFLHBPVSSRRJL-UHFFFAOYSA-N
XLogP3.71
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.24
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine?
The IUPAC name of 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine (CID 171811552) is 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine.
What is the SMILES notation for 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine?
The canonical SMILES for 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine is CCC(C)(C)c1cccc(C(F)F)n1.
What is the InChIKey of 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine?
The InChIKey is JXFLHBPVSSRRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2N/c1-4-11(2,3)9-7-5-6-8(14-9)10(12)13/h5-7,10H,4H2,1-3H3.
What are the key properties of 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine?
2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine has a molecular weight of 199.24 g/mol, XLogP of 3.71, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-(2-methylbutan-2-yl)pyridine is sourced from PubChem (CID 171811552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).